Geometry & MOs
Info
ID: |
418888 |
PubChem CID: |
135107081 |
Reduced: |
NOC9H12 (2) |
Stoich.: |
ABC9D12 (2) |
Weight, g/mol: |
669.31962 |
ΔHf, kcal/mol: |
-31.86 |
Dipole, Da: |
1.05 |
IP(EA), eV: |
-8.7(-0.08) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(7S,10R)-4-[(2S)-butan-2-yl]-17-cyclopropylsulfonyl-7-[(4-methoxyphenyl)methyl]-10-methyl-3,6,9,12,17-pentazabicyclo[17.2.2]tricosa-1(21),19,22-triene-2,5,8,11-tetrone